3-Quinuclidinyl alpha-Phenylcyclohexaneglycolate
[CAS# 29125-54-0]

Identification

• Name: 3-Quinuclidinyl alpha-Phenylcyclohexaneglycolate
• Synonyms: Quinuclidin-3-Yl 2-Cyclohexyl-2-Hydroxy-2-Phenyl-Acetate; 2-Cyclohexyl-2-Hydroxy-2-Phenylacetic Acid 3-Quinuclidinyl Ester; 2-Cyclohexyl-2-Hydroxy-2-Phenyl-Acetic Acid Quinuclidin-3-Yl Ester
• Molecular Formula: C₂₁H₂₉NO₃
• Molecular Weight: 343.47
• CAS Registry Number: 29125-54-0
• SMILES: C1=CC=CC=C1C(O)(C2CCCCC2)C(=O)OC3CN4CCC3CC4
• InChI: 1S/C21H29NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1,3-4,7-8,16,18-19,24H,2,5-6,9-15H2
• InChIKey: SWZDDEVSNRTITP-UHFFFAOYSA-N

Properties

• Density: 1.192g/cm³ (Cal.)
• Boiling point: 486.059°C at 760 mmHg (Cal.)
• Flash point: 247.76°C (Cal.)